Completing data — usually done within a minute
Basic information
- CAS
58677-42-2- Standard SMILES
Cc1ccc(S(=O)(=O)NCCNC(C)C)cc1- InChIKey
XUYSMCFRSWTUQI-UHFFFAOYSA-N- Molecular formula
- C12H20N2O2S
- Average molar mass
- 256.37 g/mol
- Monoisotopic mass
- 256.12454888
Names & identifiers
- Preferred name
- N-[2-(isopropylamino)ethyl]-p-toluenesulfonamide
- IUPAC
- 4-methyl-N-[2-(propan-2-ylamino)ethyl]benzenesulfonamide
Names & synonyms
N-[2-(isopropylamino)ethyl]-p-toluenesulfonamideSCHEMBL11772383XUYSMCFRSWTUQI-UHFFFAOYSA-NDTXSID901184727AKOS00611292058677-42-2N-[2-(isopropylamino) ethyl]-p-toluenesulfonamide4-Methyl-N-[2-[(1-methylethyl)amino]ethyl]benzenesulfonamide4-Methyl-N-{2-[(propan-2-yl)amino]ethyl}benzene-1-sulfonamide
Database identifiers
- CAS
58677-42-2- PubChem CID
- 21568614
- DTXSID
DTXSID901184727
Properties
Computed structural propertiesFilling in
- XLogP
- 1.6
- Topological polar surface area
- 66.6 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 6
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 301
Related reactions
3 records
Compound notes
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